Molecule ID: mol12008
SMILES: CC(=O)N(c1cc(C)ccc1C)N1CCNCC1
InChI: InChI=1S/C14H21N3O/c1-11-4-5-12(2)14(10-11)17(13(3)18)16-8-6-15-7-9-16/h4-5,10,15H,6-9H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.80 | IUPAC digitized pKa | 2 » 1 |
| 9.30 | IUPAC digitized pKa | 1 » 0 |